SCHEMBL5465760

SCHEMBL5465760

Cc1noc(C)c1C(=O)N1CCN(c2ccc3c(c2)CCN(C2CCCC2)CC3)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
MAPT P10636 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP2D6 P10635 3/20 0.48
HRH3 Q9Y5N1 3/20 0.48
SMN1; SMN2 Q16637 7/20 0.46
ALDH1A1 P00352 3/20 0.46
USP2 O75604 3/20 0.46
HSD17B10 Q99714 2/20 0.46
HIF1A Q16665 1/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
CYP3A4 P08684 3/20 0.46
HPGD P15428 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TMEM97 Q5BJF2 2/20 0.44
SIGMAR1 Q99720 2/20 0.44
CHRM4 P08173 1/20 0.44
HTR1A P08908 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5457320 0.81 HRH3 (0.44) CYP2D6HRH3SMN1; SMN2ALDH1A1LMNA
SCHEMBL5459964 0.80 MEN1 (0.56) TSHRMAPTKDM4ECYP2D6HRH3
SCHEMBL5466240 0.79 MEN1 (0.57) TSHRHRH3ALDH1A1USP2LMNA
SCHEMBL5464881 0.79 KDM4E (0.60) KDM4EHRH3SMN1; SMN2ALDH1A1TMEM97
SCHEMBL5455796 0.78 ATM (0.52) KDM4ECYP2D6HRH3TMEM97SIGMAR1
SCHEMBL5465874 0.78 TMEM97 (0.46) MAPTKDM4ECYP2D6HRH3ALDH1A1
SCHEMBL5459085 0.78 L3MBTL3 (0.52) MAPTKDM4EHRH3ALDH1A1HPGD
SCHEMBL5459697 0.77 L3MBTL3 (0.57) KDM4EHRH3ALDH1A1TMEM97SIGMAR1
SCHEMBL5465885 0.77 KDM4E (0.60) KDM4EHRH3ALDH1A1LMNAHTT
SCHEMBL5455010 0.77 GRIA3 (0.53) KDM4ECYP2D6HRH3ALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B TSHR 676/4885MAPT 1504/4885KDM4E 1975/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.